ethyl 2-diazo-3-oxo-4-phenoxy-butanoate
TL;DR: ethyl 2-diazo-3-oxo-4-phenoxy-butanoate (CAS 14650-51-2) is a chemical compound with molecular formula C12H12N2O4 and molecular weight 248.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-diazo-3-oxo-4-phenoxybutanoate
Also Known As: ethyl 2-diazo-3-oxo-4-phenoxy-butanoate, ETHYL 2-DIAZO-3-OXO-4-PHENOXYBUTANOATE, 2-diazonio-1-ethoxy-3-oxo-4-phenoxybut-1-en-1-olate, 2-diazonio-1-ethoxy-3-oxo-4-phenoxy-but-1-en-1-olate, (Z)-3-diazonio-4-ethoxy-4-oxo-1-phenoxybut-2-en-2-olate
| Molecular Formula | C12H12N2O4 |
|---|---|
| Molecular Weight | 248.08 g/mol |
| LogP | 0.8684 |
| Topological Polar Surface Area | 89.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 248.07971 |
| Heavy Atoms | 18 |
| Complexity | 478.1106 |
Chemical Identifiers
| CAS Number | 14650-51-2 |
|---|---|
| SMILES | CCOC(=O)C(=[N+]=[N-])C(=O)COC1=CC=CC=C1 |
Product Overview
ethyl 2-diazo-3-oxo-4-phenoxy-butanoate (CAS 14650-51-2), with molecular formula C12H12N2O4 and molecular weight 248.08 g/mol. IUPAC: ethyl 2-diazo-3-oxo-4-phenoxybutanoate.
Chemical Property Profile of ethyl 2-diazo-3-oxo-4-phenoxy-butanoate
Property Insights of ethyl 2-diazo-3-oxo-4-phenoxy-butanoate
The XLogP value of 0.8684 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 2-diazo-3-oxo-4-phenoxy-butanoate. The TPSA of 89.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-diazo-3-oxo-4-phenoxy-butanoate. Following Lipinski's Rule of Five, ethyl 2-diazo-3-oxo-4-phenoxy-butanoate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl 2-diazo-3-oxo-4-phenoxy-butanoate?
The CAS number of ethyl 2-diazo-3-oxo-4-phenoxy-butanoate is 14650-51-2.
What is the molecular formula of ethyl 2-diazo-3-oxo-4-phenoxy-butanoate?
The molecular formula of ethyl 2-diazo-3-oxo-4-phenoxy-butanoate is C12H12N2O4.
What is the molecular weight of ethyl 2-diazo-3-oxo-4-phenoxy-butanoate?
The molecular weight of ethyl 2-diazo-3-oxo-4-phenoxy-butanoate is 248.08 g/mol.
Where can I buy ethyl 2-diazo-3-oxo-4-phenoxy-butanoate?
You can request a quote for ethyl 2-diazo-3-oxo-4-phenoxy-butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-diazo-3-oxo-4-phenoxy-butanoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-diazo-3-oxo-4-phenoxy-butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.